diethyl {[(2-hydroxy-3-(4-phenoxy)propyl)amino](p-tolyl)methyl}phosphonate | 1246495-52-2

• 英文名称: diethyl {[(2-hydroxy-3-(4-phenoxy)propyl)amino](p-tolyl)methyl}phosphonate
• CAS: 1246495-52-2
• 化学式: C₂₁H₃₀NO₅P
• 分子量: 407.447
• InChiKey: NJTBODCMVRAERX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.29
• 重原子数：
  28.0
• 可旋转键数：
  12.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  77.02
• 氢给体数：
  2.0
• 氢受体数：
  6.0

反应信息

• 作为产物：
  描述：

  p-Toluylaldehyd-imin 反应 17.5h， 生成 diethyl {[(2-hydroxy-3-(4-phenoxy)propyl)amino](p-tolyl)methyl}phosphonate
  参考文献：
  名称：

  (氨基甲基)膦酸盐与环氧化物的无溶剂和无催化剂反应：新型{[(2-羟乙基)氨基]甲基}膦酸盐的合成

  摘要：

  AbstractUncatalyzed reaction of epoxides with (aminomethyl)phosphonates for the synthesis of novel {[(2‐hydroxyethyl)amino]methyl}phosphonates is described. Treatment of (aminomethyl)phosphonates with epoxides without any catalyst and under solvent‐free conditions gives novel {[(2‐hydroxyethyl)amino]methyl}phosphonates. Using this method, a series of {[(2‐hydroxyethyl)amino]methyl}phosphonates was synthesized in good yields. © 2010 Wiley Periodicals, Inc. Heteroatom Chem 21:284–289, 2010; Published online in Wiley InterScience (www.interscience.wiley.com). DOI 10.1002/hc.20615

  DOI：

  10.1002/hc.20615